1-Chloro-7-methylisoquinoline - CAS 24188-80-5

Catalog:	BB018363
Product Name:	1-Chloro-7-methylisoquinoline
CAS:	24188-80-5
Synonyms:	1-chloro-7-methylisoquinoline; 1-chloro-7-methylisoquinoline

Technical Data

Patents

Computed Properties

IUPAC Name:	1-chloro-7-methylisoquinoline
Description:	1-Chloro-7-methylisoquinoline (CAS# 24188-80-5) is a useful research chemical.
Molecular Weight:	177.63
Molecular Formula:	C10H8ClN
Canonical SMILES:	CC1=CC2=C(C=C1)C=CN=C2Cl
InChI:	InChI=1S/C10H8ClN/c1-7-2-3-8-4-5-12-10(11)9(8)6-7/h2-6H,1H3
InChI Key:	FBQJSTRRHBTMMQ-UHFFFAOYSA-N
Boiling Point:	284.844 °C at 760 mmHg
Density:	1.225 g/cm³
LogP:	3.19660

Publication Number	Title	Priority Date
CN-110627836-A	Red phosphorescent compound and organic electroluminescent device using the same	20190829
WO-2020163193-A1	Bicyclic ether o-glycoprotein-2-acetamido-2-deoxy-3-d-glucopyranosidase inhibitors	20190204
TW-202045501-A	Bicyclic ether o-glycoprotein-2-acetamido-2-de oxy-3-d-glucopyranosidase inhibitors	20190204
EP-3562821-B9	Isoquinoline compounds, methods for their preparation, and therapeutic uses thereof in conditions associated with the alteration of the activity of beta galactosidase	20161228
AU-2015366469-B2	Antibacterial compounds having broad spectrum of activity	20141217

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Complexity:	160
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	177.034527
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	177.034527
Rotatable Bond Count:	0
Topological Polar Surface Area:	12.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.4